Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Histone deacetylase 1' and Ligand = 'BDBM50320761'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Histone deacetylase 1 (Homo sapiens (Human))	BDBM50320761 (CHEMBL1163973 | N-(2-Aminophenyl)-4-(((2-hydroxyet...) Show SMILES Nc1ccccc1NC(=O)c1ccc(CN(CCO)Cc2ccc(cc2)-c2cccs2)cc1 Show InChI InChI=1S/C27H27N3O2S/c28-24-4-1-2-5-25(24)29-27(32)23-13-9-21(10-14-23)19-30(15-16-31)18-20-7-11-22(12-8-20)26-6-3-17-33-26/h1-14,17,31H,15-16,18-19,28H2,(H,29,32)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	800	n/a	n/a	n/a	n/a	n/a	n/a
Kansai University Curated by ChEMBL					Assay Description Inhibition of HDAC1				Bioorg Med Chem 18: 3925-33 (2010) Article DOI: 10.1016/j.bmc.2010.04.033 BindingDB Entry DOI: 10.7270/Q29S1R6H
					More data for this Ligand-Target Pair